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t-BDMS ester of cholanic acid
SpectraBase Compound ID mmhyuRm8xO
InChI InChI=1S/C30H54O2Si/c1-21(12-17-27(31)32-33(7,8)28(2,3)4)24-15-16-25-23-14-13-22-11-9-10-19-29(22,5)26(23)18-20-30(24,25)6/h21-26H,9-20H2,1-8H3/t21-,22+,23+,24-,25+,26+,29+,30-/m1/s1
InChIKey CHBDCNXLOQRHNQ-GHMIKJNZSA-N
Mol Weight 474.8 g/mol
Molecular Formula C30H54O2Si
Exact Mass 474.389308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G32CLTdHvaC
Name t-BDMS ester of cholanic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H54O2Si
InChI InChI=1S/C30H54O2Si/c1-21(12-17-27(31)32-33(7,8)28(2,3)4)24-15-16-25-23-14-13-22-11-9-10-19-29(22,5)26(23)18-20-30(24,25)6/h21-26H,9-20H2,1-8H3/t21-,22+,23+,24-,25+,26+,29+,30-/m1/s1
InChIKey CHBDCNXLOQRHNQ-GHMIKJNZSA-N
Molecular Weight 474.845 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@]4([C@]([C@]3(CC2)[H])(C)CCCC4)[H])[H])(CC[C@@]1([C@@](CCC(O[Si](C(C)(C)C)(C)C)=O)(C)[H])[H])[H])C
SPLASH splash10-014i-3310900000-c7d826cd8b8fee29380a
Source of Spectrum KO-19-510-3
Synonyms (t-butyl)dimethylsilyl 5.beta.-cholan-24-oate tert-Butyl(dimethyl)silyl (5beta)-cholan-24-oate
Wiley ID 1394019